15Z
Summary
| Name: | 2-(3,4-dihydroxyphenyl)-7-hydroxy-4H-chromen-4-one |
| Synonyms: | 7,3',4'-Trihydroxyflavone |
| Formula: | C15 H10 O5 |
| Formal charge: | 0 |
| Formula weight: | 270.237 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(3,4-dihydroxyphenyl)-7-hydroxy-4H-chromen-4-one |
| OpenEye OEToolkits | 1.7.6 | 2-[3,4-bis(oxidanyl)phenyl]-7-oxidanyl-chromen-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1c3c(OC(=C1)c2ccc(O)c(O)c2)cc(O)cc3 |
| InChI | InChI | 1.03 | InChI=1S/C15H10O5/c16-9-2-3-10-12(18)7-14(20-15(10)6-9)8-1-4-11(17)13(19)5-8/h1-7,16-17,19H |
| InChIKey | InChI | 1.03 | PVFGJHYLIHMCQD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Oc1ccc2C(=O)C=C(Oc2c1)c3ccc(O)c(O)c3 |
| SMILES | CACTVS | 3.370 | Oc1ccc2C(=O)C=C(Oc2c1)c3ccc(O)c(O)c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(c(cc1C2=CC(=O)c3ccc(cc3O2)O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(c(cc1C2=CC(=O)c3ccc(cc3O2)O)O)O |
